ID: 89335
SMILES:O=C(CC1(C)Oc2c(c(O)cc(CCCC(O)C)c2)C(C)C=CC2C(C)CCC12)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -14.26
InChIKey:XTUGVPYLMZIXNY-UHFFFAOYSA-N
ID: 89336
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CC=C(C(OC)=O)C1(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -12.728
InChIKey:WBOQOBODAHMJLB-UHFFFAOYSA-N
ID: 89337
SMILES:OC(=NC1(C)C2CC=C(C)CC2c2c(O)cc(CCC)c(C=O)c2O1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.45
CB1 binding score: -14.843
InChIKey:BNFTWWOZKVONSL-UHFFFAOYSA-N
ID: 89338
SMILES:C(CCCC)c1cc(O)cc2c1C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.133
InChIKey:NWNXONBQZMRACD-UHFFFAOYSA-N
ID: 89339
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 89340
SMILES:C(=CCC1(O)C2c3c(cc(CCCCC)cc3O)OC(C)(CCC=C=C)C2CC1=O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.608
CB1 binding score: -14.263
InChIKey:UHXOJHDLOGTEHC-UHFFFAOYSA-N
ID: 89341
SMILES:O1C(CCC=C(C)C)(C)C=Cc2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 89342
SMILES:CC(=CCc1c(O)cc(CCc2ccc(O)cc2)cc1OC)CCC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -17.892
InChIKey:YMOPWTOOBMUWAW-UHFFFAOYSA-N
ID: 89343
SMILES:c1(CCCCC)c(O)c(O)c2c(c1)CC1(O)OC(C)(C)C3C1(CCC(C)(O)C3C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.546
CB1 binding score: -14.625
InChIKey:ZQNSDHFBLBLBAW-UHFFFAOYSA-N
ID: 89344
SMILES:C1C(=O)C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.88
InChIKey:UBLVLGBCMDWGPP-UHFFFAOYSA-N
ID: 89345
SMILES:C(C(O)CCCCC)C(=O)c1c(O)cc(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -12.868
InChIKey:UHHLBROGEOGZLZ-UHFFFAOYSA-N
ID: 89346
SMILES:O(C(=O)c1cc(CCCCC)cc2c1C1C(C(C)(O)CCC1C(C)=C)O2)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.168
InChIKey:IERXVRDGUDMQAN-UHFFFAOYSA-N
ID: 89347
SMILES:C1C2=C(c3c(O)c4c(cc3CCCCC)OC(C)(C)C3CC(OC3C=C(CO)C)C13C(=O)OC1OC13C)CC(=O)C(C)=C24
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 590.713
CB1 binding score: -16.731
InChIKey:BWIZFKICDXAWHA-UHFFFAOYSA-N
ID: 89348
SMILES:c12c(OC)cc(CCCCC)cc1OC(CCC=C(C)C)(C)C1CCC(C(=O)O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.864
InChIKey:LPCDMMWXOOABIL-UHFFFAOYSA-N
ID: 89349
SMILES:c1(O)c(C2C=C(CO)CCC2C(=C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -20.344
InChIKey:ZELUXPWDPVXUEI-UHFFFAOYSA-N
ID: 89350
SMILES:C(O)(CCCC)c1cc(OC)c2c(c1)OC(C)(C)C1=C2CC(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.905
InChIKey:XUJPDNNUWXUFMN-UHFFFAOYSA-N
ID: 89351
SMILES:O=C(C1=CC2C(C(C)(C)Oc3cc(CCCCCCC)cc(O)c32)CC1=O)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -17.792
InChIKey:UOYFDZSHVSRMIL-UHFFFAOYSA-N
ID: 89352
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C(=O)OC)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.943
InChIKey:CCMWHLPOQSRJEP-UHFFFAOYSA-N
ID: 89353
SMILES:c1(CC=CCC)cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -17.717
InChIKey:WWHZEOCJUSEJSW-UHFFFAOYSA-N
ID: 89354
SMILES:c1(CCCCC)cc2c(c(O)c1)C=CC(CCC=C(C)C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 89355
SMILES:c12c(c(CCCC(C)C)c(C)cc1O)CCC1C(C)(C)OC3CC(=O)OC23C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -14.601
InChIKey:RSLYZFZRCLUQSC-UHFFFAOYSA-N