ID: 79192
SMILES:CC(C1CCC(C)=C(OC2OC(CO)C(O)C(O)C2O)C1c1c(O)cc(CCCCCO)cc1OC)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 522.635
CB1 binding score: -15.937
InChIKey:DBCQSAXJWUMYCK-UHFFFAOYSA-N
ID: 79193
SMILES:C=C(C1CCC(C)=CC1c1c(O)cc(CC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N
ID: 79194
SMILES:C(C)(=O)OC(C)(C)C(Cc1c2c(cc3c(c2O)CC2C=C(C)CCC2C(C)(C)O3)=C(Cc2ccccc2)OC1(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.742
CB1 binding score: -13.505
InChIKey:PZGZXASAAUZAQO-UHFFFAOYSA-N
ID: 79195
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)(C)O)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.012
InChIKey:PUPJCCREXYFOTO-UHFFFAOYSA-N
ID: 79196
SMILES:C(C=CCCC)Oc1ccc(Cl)c2c1CC(C(C)=C)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 429.044
CB1 binding score: -13.749
InChIKey:UJUSTSNVJBFZRE-UHFFFAOYSA-N
ID: 79197
SMILES:OC(C)(CO)CCCC1=CC(c2c(O)ccc(CCCC)c2)CC(C)C12Cc1c(c(C(C)=O)c(O)c(C)c1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 552.708
CB1 binding score: -16.352
InChIKey:YXHHRUNRJKJEMM-UHFFFAOYSA-N
ID: 79198
SMILES:C1C(C)=CC(c2c(O)cc(C)cc2OC)C(C(CCC=C(C)CO)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: Not available
InChIKey:IEPKCWNKSYVMFO-UHFFFAOYSA-N
ID: 79199
SMILES:C1C2C(C)(C)C2C2C(C(C)=O)Oc3c(c(O)cc(CCCCC)c3)C2CC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -14.647
InChIKey:RYOZITZMSXBAJW-UHFFFAOYSA-N
ID: 79200
SMILES:O1c2c(c(O)cc(O)c2C(O)=O)C2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1=CC(C)(C)OO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.571
CB1 binding score: -18.701
InChIKey:VUBYOXKDMUPGES-UHFFFAOYSA-N
ID: 79201
SMILES:C12C(C)(Oc3c(c(OC)cc(CCCCC)c3)C1)CCC(C)(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -15.526
InChIKey:UQSLSEFRDQWSDQ-UHFFFAOYSA-N
ID: 79202
SMILES:C1C2C(C)(C3C(=C1O)c1c(cc(CCCCC)cc1O)OC3=O)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -12.721
InChIKey:AQVDKWSWQLSHOQ-UHFFFAOYSA-N
ID: 79203
SMILES:COc1c2c(c(C)c(CCC=CC)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -13.738
InChIKey:QELMFLPOIMQRJD-UHFFFAOYSA-N
ID: 79204
SMILES:OC1(C)C(O)CCC(C)=CCc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -15.564
InChIKey:TWPNVPRLJDDABH-UHFFFAOYSA-N
ID: 79205
SMILES:C1(C(O)C=C(CCC=C(C)C)C)Oc2c(c(O)cc(CCC)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.312
InChIKey:SWVNSXKUEBIRQN-UHFFFAOYSA-N
ID: 79206
SMILES:C(Cc1c(O)ccc(CCCCC)c1)=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 300.486
CB1 binding score: -19.441
InChIKey:VPIIPBDTVZXIEC-UHFFFAOYSA-N
ID: 79207
SMILES:C1C(C)=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 79208
SMILES:c1(C)c(O)c(CCCCC)cc2c1C1CC(C)=CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.482
InChIKey:QKOFZSYTVMLRBN-UHFFFAOYSA-N
ID: 79209
SMILES:C(Cc1c(O)c(C(=O)O)c(CCCCC)cc1O)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Aromatic polyketides
Class: Cannabinoids;Catechols with side chains
MW: 320.429
CB1 binding score: -13.716
InChIKey:PAEBGQMRZQDCRS-UHFFFAOYSA-N
ID: 79210
SMILES:C1(O)C(C(C)C)C(c2c(O)cc(CCCCC)cc2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -13.827
InChIKey:WWYXTUUSZKOTDL-UHFFFAOYSA-N
ID: 79211
SMILES:O=C(OCC)Oc1c(CCCCC)cc(O)c2c1OC1(C(C(C)C)=O)C2C=C(C)CCC1C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.649
CB1 binding score: -16.384
InChIKey:LMEOGIQHDMIWMS-UHFFFAOYSA-N
ID: 79212
SMILES:C(CC(O)(C1Cc2c(O)c(C(=O)O)cc(CCCCCCO)c2)CC(C)=CCC1)C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 458.639
CB1 binding score: -14.196
InChIKey:OGPQTLFCXZAQHU-UHFFFAOYSA-N