ID: 73228
SMILES:C(C)(C)=CCCC(=CCCC(=CCc1c(O)cc(CCCCCO)cc1O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.603
CB1 binding score: -16.782
InChIKey:ZKKSUUGHFOIVDB-UHFFFAOYSA-N
ID: 73229
SMILES:CC1=CC2c3c(O)cc(C)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -20.957
InChIKey:WIDIPARNVYRVNW-UHFFFAOYSA-N
ID: 73230
SMILES:CC(C)=CCCC(=CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -14.959
InChIKey:YONBVYJYQJTFMD-UHFFFAOYSA-N
ID: 73231
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.534
InChIKey:INKUWBOHCFHXTJ-UHFFFAOYSA-N
ID: 73232
SMILES:CCCCCc1cc2c(cc1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.716
InChIKey:MMMBBXWSLJXQAV-UHFFFAOYSA-N
ID: 73233
SMILES:C1CC(C)CC2(O)c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.007
InChIKey:FXSXHYVMKQBBKA-UHFFFAOYSA-N
ID: 73234
SMILES:Oc1c(OC(=O)C)c(C)c2c(c1CCC)CC1(O2)CC=CC(C)(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.608
InChIKey:CVQGQCLROCQCHM-UHFFFAOYSA-N
ID: 73235
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 73236
SMILES:Oc1c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 73237
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C(=O)CC1C(C(C)C)CCC(C)C1)C(C(OC)=O)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 474.638
CB1 binding score: -15.222
InChIKey:AXIQHRRXWHXFQG-UHFFFAOYSA-N
ID: 73238
SMILES:C1(C)(C)C(c2c(O)ccc(CCCCC)c2)CC(C)=CCC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -14.72
InChIKey:VNNMCJNYCNWVRS-UHFFFAOYSA-N
ID: 73239
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 73240
SMILES:c1c(CCC(COC(C(=CC)C)=O)C(C=O)=COC(=O)Cc2ccc(O)cc2)c(O)cc(O)c1C1C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 602.724
CB1 binding score: -13.195
InChIKey:HJQRYUTUNXUVFT-UHFFFAOYSA-N
ID: 73241
SMILES:C1CC(CCOC(CC)=O)C(C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.507
InChIKey:KKZYESIXYSNTDU-UHFFFAOYSA-N
ID: 73242
SMILES:C(CCCC)Cc1cc2c(cc1O)C1=C(C(C)(C)O2)CC(C)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -15.856
InChIKey:HSALLTPXUFTELG-UHFFFAOYSA-N
ID: 73243
SMILES:C1(C)=CCC2C(C)(C)Oc3ccc(OC)cc3C2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -15.184
InChIKey:MPDSTNQVQUHFFB-UHFFFAOYSA-N
ID: 73244
SMILES:CC1(C)CC2(C)C3Oc4c(c(O)cc(CCCC)c4)C3(C)C(C)CC2(O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -16.078
InChIKey:JELKJADNHSEMQM-UHFFFAOYSA-N
ID: 73245
SMILES:O(CC(N)CSCC=C(C)CCC=C(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 421.647
CB1 binding score: -16.047
InChIKey:USCOFKYEBMRGPC-UHFFFAOYSA-N
ID: 73246
SMILES:O=C(c1c(NC(CCCc2cc(OC)c(CC=C(C)CCC=C(C)C)c(O)c2)=O)cccc1)OC=CC(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 531.693
CB1 binding score: -14.584
InChIKey:MFIDEAJARUDPQM-UHFFFAOYSA-N
ID: 73247
SMILES:C1C2(C)Oc3c(c(O)cc(CCCCC)c3)C(C(CCC=C(C)C)(C)O)C2C=C(C)C(OC(=O)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 498.704
CB1 binding score: -14.128
InChIKey:LMDHCPBXWAXWAA-UHFFFAOYSA-N
ID: 73248
SMILES:C(C1=C2C3(CC1=O)C(C)(CC(O)C1OC1(C)C)C=CCC3(C)O2)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.509
InChIKey:LWIAIJJXUAWQBR-UHFFFAOYSA-N