ID: 56197
SMILES:c1(CCCCCC)cc2c(c(O)c1)C1CC(C(CCC=C(C)C)(O)C)OC1C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -13.026
InChIKey:ULOKXNWDUOJELJ-UHFFFAOYSA-N
ID: 56198
SMILES:C(CC)CCCCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -18.354
InChIKey:OJTMRZHYTZMJKX-UHFFFAOYSA-N
ID: 56199
SMILES:C(C1(c2c(O)cc(CCCCC)cc2O)CCC(C)=C1C)CCC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.565
CB1 binding score: -13.277
InChIKey:HPWYFEPIYSDLPJ-UHFFFAOYSA-N
ID: 56200
SMILES:C1=C(C)CC2C(C1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 56201
SMILES:C(CCCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 56202
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CC(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -17.185
InChIKey:XAHCMGICRXXZNM-UHFFFAOYSA-N
ID: 56203
SMILES:CC1CCC(c2c(O)cc(CCCCC)cc2O)(C)CCC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -13.586
InChIKey:XVABDULWGLGXRK-UHFFFAOYSA-N
ID: 56204
SMILES:c1(CCCCC)cc2c(c(O)c1C=O)OC(C)(C)C(O)CCC(=C)C#C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -14.435
InChIKey:FNIXLOXWQCTPJP-UHFFFAOYSA-N
ID: 56205
SMILES:C12C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 56206
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C=O)c1O)CCC=C(C(=O)O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.477
CB1 binding score: -15.534
InChIKey:OSDKJPCKAIRJQA-UHFFFAOYSA-N
ID: 56207
SMILES:C1=CC2=Cc3c(O)cc(CCCCC)cc3OC(C2(C)C)CC1(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -13.89
InChIKey:KSSXXTZKHHWWOW-UHFFFAOYSA-N
ID: 56208
SMILES:CCC(O)Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1C1C=C(CCC)C(=O)C=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.662
CB1 binding score: -15.929
InChIKey:WDVJLIMQXWFRJA-UHFFFAOYSA-N
ID: 56209
SMILES:O(CC)c1c(C(=O)OC)c(CCCCC)cc(OC(=O)C)c1C1C(C(CCC=C(C)C)=C)CCC(=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.715
CB1 binding score: -15.551
InChIKey:OMCCIGYZYSQVDL-UHFFFAOYSA-N
ID: 56210
SMILES:c1(O)c2c(cc(C(CCC)(C)C)c1)OC(CO)(C)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 278.392
CB1 binding score: -15.091
InChIKey:UAIBNCMQIQANBF-UHFFFAOYSA-N
ID: 56211
SMILES:c1(CC(CC2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(C)(C)C2C)C)occ(C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 442.596
CB1 binding score: -16.742
InChIKey:UCCBREWOGTVEMS-UHFFFAOYSA-N
ID: 56212
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(CCC1C(C)(C)CCC=C1C)(CCC=C(C)C)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.678
CB1 binding score: -13.787
InChIKey:UAHABAURHJXDHE-UHFFFAOYSA-N
ID: 56213
SMILES:c1(C(c2oc(=O)c(C3C=C(C)CCC3C(C)CCC=C(C)C)c(O)c2)C=C(C)CCC(O)C(C)(O)C)cc(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 578.79
CB1 binding score: -15.633
InChIKey:GBSMFEVNMFUIRW-UHFFFAOYSA-N
ID: 56214
SMILES:c1(CCCCC)c(C(OC)=O)c(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 374.521
CB1 binding score: -19.567
InChIKey:RSOBBJCWWQRAAM-UHFFFAOYSA-N
ID: 56215
SMILES:C(C=C(C)C)CC(=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 428.613
CB1 binding score: -18.353
InChIKey:QNRJPRFPLQBROG-UHFFFAOYSA-N
ID: 56216
SMILES:CC12CCC(C)=CC1c1c(cc(CCCCC)c(C(=O)OC)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.714
InChIKey:ZCBMWIKLIOWKPV-UHFFFAOYSA-N
ID: 56217
SMILES:C12C(C=CC1C)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.037
InChIKey:NOLPUPUOWSCBMP-UHFFFAOYSA-N