ID: 116320
SMILES:C1(=O)C2(Oc3c1c(O)cc(CCC)c3)C(C)CCC(C(C)=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -11.583
InChIKey:PZLGGTGTZDSSIW-UHFFFAOYSA-N
ID: 116321
SMILES:C1(N)=C(C(C(C)CC)=O)C(=O)C2=C1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.44
CB1 binding score: -16.438
InChIKey:ISTJLTFGSNVHBK-UHFFFAOYSA-N
ID: 116322
SMILES:CC(=CCc1c(OC)cc(CCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.432
InChIKey:SGCYLRZOKBHTMC-UHFFFAOYSA-N
ID: 116323
SMILES:C1C(C(O)(C)C)C(c2c(O)cc(CCC)cc2O)CC(C)(Cl)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.891
CB1 binding score: -13.435
InChIKey:ZGHGBEVQTKEIRM-UHFFFAOYSA-N
ID: 116324
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 116325
SMILES:O=C1C2C(CCC=C(C)C)(C)Oc3cc(CCCCC)cc(O)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -15.374
InChIKey:XULBNVSYRLQJEO-UHFFFAOYSA-N
ID: 116326
SMILES:C12C(C)(C)Oc3cc(C)c(Br)cc3C1CC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 321.258
CB1 binding score: -17.7
InChIKey:JVAPHQAMSGYOEB-UHFFFAOYSA-N
ID: 116327
SMILES:C1C(C(C)=C)C(c2cc(CCCCC)ccc2OC)C(C(=C)C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.524
CB1 binding score: -15.256
InChIKey:YMSOOXBMQCELRL-UHFFFAOYSA-N
ID: 116328
SMILES:CC1(C)C2C=CC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -20.121
InChIKey:PJBASZVNRDGSFZ-UHFFFAOYSA-N
ID: 116329
SMILES:C1(C)CC2c3c(O)cc(C(CCCCCCCCC)O)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -16.028
InChIKey:LELAVKVBFBLDCU-UHFFFAOYSA-N
ID: 116330
SMILES:c1(O)c(Cc2cc(O)c3c(c2)OC(C)(C)C2C3C=C(C)CC2)cc(O)c2c1OC1(C)C(C(C)CCC3C(C)(C)C13)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 572.786
CB1 binding score: -15.647
InChIKey:HLEURAKVGVNUKQ-UHFFFAOYSA-N
ID: 116331
SMILES:c1cc(Oc2c(C(C(C)CC)=O)c3c(c(O)c2)CC2C(C)(C)CCCC2(C)O3)c2c3c1OC(C)(C)C(C2)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.694
CB1 binding score: -14.503
InChIKey:XHFMCXFLDKHSON-UHFFFAOYSA-N
ID: 116332
SMILES:CC(=CCCC(=CCC12Oc3c(O)cc(C)cc3C(=O)C1C(C)CC=C2)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.528
CB1 binding score: Not available
InChIKey:NBFKZHNOBNXNQY-UHFFFAOYSA-N
ID: 116333
SMILES:COc1cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -18.286
InChIKey:VBGLQLUQKZRKHZ-UHFFFAOYSA-N
ID: 116334
SMILES:N(C(C1CCC2(C)Oc3c(c(O)cc(C)c3)C21)=C)(C(O)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 303.358
CB1 binding score: -15.079
InChIKey:UQEVQHRPTSGDCH-UHFFFAOYSA-N
ID: 116335
SMILES:c1(O)cc(CCC)cc2c1C1C(C(C)(C)OO2)CCC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -13.254
InChIKey:CFDDIBDPSYWQIP-UHFFFAOYSA-N
ID: 116336
SMILES:OC(C(O)C1CC(O)C(=C)C2CC(C(C)=C)CCC21C)c1c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.676
CB1 binding score: -15.739
InChIKey:LMFJYOFDBOZRMX-UHFFFAOYSA-N
ID: 116337
SMILES:Oc1c(CC=C(C)C)cc(CCCCC)cc1C1C(C(C)C)CCC(O)(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.62
CB1 binding score: -12.769
InChIKey:YBSWTHYFWHQBKI-UHFFFAOYSA-N
ID: 116338
SMILES:C1(c2ccc(O)cc2)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -16.028
InChIKey:TYBSOLGXAASVEP-UHFFFAOYSA-N
ID: 116339
SMILES:C1C(C(C)C)C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.27
InChIKey:WPJGAEFIBVPIDI-UHFFFAOYSA-N
ID: 116340
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -18.786
InChIKey:YURJBXYTSFIOOT-UHFFFAOYSA-N