ID: 97315
SMILES:c12c(c(O)cc(CCC(O)C)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.292
InChIKey:HWUNZNLHTIODBY-UHFFFAOYSA-N
ID: 97316
SMILES:Cc1c(O)cc2c(c1)-c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.436
CB1 binding score: -18.225
InChIKey:XUERFRQVGLONMR-UHFFFAOYSA-N
ID: 97317
SMILES:c1(C)cc(O)cc2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.76
InChIKey:QSENNOHYZPYNTR-UHFFFAOYSA-N
ID: 97318
SMILES:CC1(C)C2C3(c4c(cc(CCCCC)cc4O)OC1C3)CCC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.228
InChIKey:LKUYVNISVGEYHB-UHFFFAOYSA-N
ID: 97319
SMILES:CC1(C)Oc2cc(CCCCCO)cc(O)c2C2C3OC(C(O)(C)CCC12)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.492
CB1 binding score: -16.609
InChIKey:FKSDNBPTCMJLTL-UHFFFAOYSA-N
ID: 97320
SMILES:OC1C(C)C2=CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.837
InChIKey:NISCNQPKCBRXCT-UHFFFAOYSA-N
ID: 97321
SMILES:CC(=O)Oc1cc2c(cc1CCCCC)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.199
InChIKey:HGOUZDOJAIERRN-UHFFFAOYSA-N
ID: 97322
SMILES:C(C)(C=C)(CC(c1c2c(ccc1O)OC(C)(C)C1C2C=C(C)CC1)O)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.605
InChIKey:VCYUWWPUJZQOTO-UHFFFAOYSA-N
ID: 97323
SMILES:C(c1ccccc1)CC(=O)c1cc(OC)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Flavonoids
Class: Cannabinoids;Chalcones
MW: 390.523
CB1 binding score: -13.687
InChIKey:AQCNTRNDMIOGCA-UHFFFAOYSA-N
ID: 97324
SMILES:CC1=CC2C(c3c(OC)cc(CCC(CC)O)cc3O2)C(C(C)=C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.438
InChIKey:VCCHWWXUEJOYKL-UHFFFAOYSA-N
ID: 97325
SMILES:c1c2c(cc(OC)c1O)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.359
CB1 binding score: -15.358
InChIKey:RNUAWLCJYCKYCO-UHFFFAOYSA-N
ID: 97326
SMILES:C1C(C)=CC(c2ccc(CCCCC)cc2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 282.471
CB1 binding score: -19.804
InChIKey:VGBLUPCGCQUYRW-UHFFFAOYSA-N
ID: 97327
SMILES:c1c2c(ccc1)C1C3C(C(CC)C=C1)C(C(=O)CC(C)C)=C(O)C3(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.474
CB1 binding score: -13.108
InChIKey:IDZWFFYJRGEISR-UHFFFAOYSA-N
ID: 97328
SMILES:C1(CC2c3c(cc(CCCCC)cc3O)OC2(O)C)C(=O)c2c(O)cc(O)cc2CC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.509
CB1 binding score: -15.05
InChIKey:LKGMLTZUSUVKNA-UHFFFAOYSA-N
ID: 97329
SMILES:CC1C2C(c3c4c(cc(=O)cc3C)OC(C)(C)C3C4=C(C)CCC13)OC(CCCCCCCCCCC)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 518.782
CB1 binding score: -15.687
InChIKey:HNJCXMXRQXJQMZ-UHFFFAOYSA-N
ID: 97330
SMILES:C(=CCCC(=CCc1c(O)cc(CCCCC)c(O)c1O)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.433
InChIKey:PQJHNORQVFURSH-UHFFFAOYSA-N
ID: 97331
SMILES:CC(=O)Cc1c(O)cc2c(c1O)C=CC(CCC1(C)C=CCC(C)(C)O1)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -14.886
InChIKey:FRSAQZPNIJHGKU-UHFFFAOYSA-N
ID: 97332
SMILES:c1c(O)cc(C2C=C(C)CC(c3c(OC)ccc(CCN(C)C)c3)C2C(C)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.582
CB1 binding score: -12.794
InChIKey:QGXYWHNNWSLCQY-UHFFFAOYSA-N
ID: 97333
SMILES:C(=C(C)C)CCC(C)=CCc1c(O)c(C(=O)c2ccccc2)c(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -17.334
InChIKey:UMHCSCLPPBUGMJ-UHFFFAOYSA-N
ID: 97334
SMILES:C1CC(C(C)=C)C(c2c(O)cc(C)cc2O)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 97335
SMILES:Oc1c2c(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