ID: 16423
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C(=O)O)CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.605
InChIKey:FKOKPCOQLHSURS-UHFFFAOYSA-N
ID: 16424
SMILES:CC(C1CC2C3(C)CC1c1c(O)c(C(=O)O)c(CCCCC)cc1OC23)CCC(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -13.989
InChIKey:NHGMNYWSAZXTLE-UHFFFAOYSA-N
ID: 16425
SMILES:C(CCC(C)c1c(O)cc2c(c1)OC(C)(C)C1C2CC(C)CC1)CC1=C(C)CCCC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.723
CB1 binding score: -15.241
InChIKey:ATSBXSBRUUFCFN-UHFFFAOYSA-N
ID: 16426
SMILES:CC(C)=CCc1c2c(c(O)c(CCC(C(C)=C)O)c1C)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -16.174
InChIKey:PPTGZJGSXZRUHR-UHFFFAOYSA-N
ID: 16427
SMILES:Oc1c2c(cc3c1c1c(c(C(C(C)C)=O)c3O)OCC(CC=CC(=CO)C)(C)O1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 548.676
CB1 binding score: -14.412
InChIKey:JBSBLQGTUZGZQM-UHFFFAOYSA-N
ID: 16428
SMILES:C1(C)C(C)(C)Oc2cc(CCCCC)c(O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -15.291
InChIKey:OXWDRJYMQLUPJS-UHFFFAOYSA-N
ID: 16429
SMILES:CC(=CCCC(C)(O)C1Oc2cc(CCCCC)c(C(O)=O)c(O)c2C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -17.405
InChIKey:WSVZXDFRHRICAL-UHFFFAOYSA-N
ID: 16430
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 16431
SMILES:c1(OC)cc2c(cc1CCCCC)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.982
InChIKey:GLUWKBFJPNDEDK-UHFFFAOYSA-N
ID: 16432
SMILES:C(CC(CC=C(C)CCC=C(C)C)CC=C(C)C)(=O)c1c(O)c(C2C=C(C)CCC2C(C)C)c(O)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 536.797
CB1 binding score: -14.267
InChIKey:LXYMGNAHIPNBEG-UHFFFAOYSA-N
ID: 16433
SMILES:C1C(C)=CCCC12C1c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -15.394
InChIKey:KHHHOXFFNHBEGQ-UHFFFAOYSA-N
ID: 16434
SMILES:C(C=C(C)C)c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 16435
SMILES:CC(=CCC1C(C)(C)Oc2c1c(O)cc(CCCCC)c2O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -17.75
InChIKey:NAQOIVQGEYYRQE-UHFFFAOYSA-N
ID: 16436
SMILES:C(=C(C)C)Cc1c(O)c2c(cc1)C1C(C(C)(C)O2)CC=C(C)C1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.572
CB1 binding score: -15.038
InChIKey:SRMNQQWWZALMHD-UHFFFAOYSA-N
ID: 16437
SMILES:C1CCC2C(c3c(O)cc(CCCCC)cc3O2)C(C=C(C)C)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.949
InChIKey:YPJHTSSCIUVGSU-UHFFFAOYSA-N
ID: 16438
SMILES:C1C(C(C)(C)O)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 16439
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2-c2cc(O)cc(O)c2)C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -13.89
InChIKey:ODSXEKMOAZSYGN-UHFFFAOYSA-N
ID: 16440
SMILES:O(Cc1cccc2c3c(c(O)c(=O)c(CCCCC)c31)OC1(C)C(OC(C(C)(C)O)C1)C2)C(C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.589
CB1 binding score: -16.393
InChIKey:NITINIIZDINMSH-UHFFFAOYSA-N
ID: 16441
SMILES:C1(C(C)C)C(c2cc(CCCCC)cc(O)c2)C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.815
InChIKey:DRUFHBDSPNWCGG-UHFFFAOYSA-N
ID: 16442
SMILES:C(C)(CCC=C(C)C)=CCc1c(O)cc(CO)c2c1C1C(C(C)(C)O2)CC(O)C(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -15.19
InChIKey:KBQFWXFOVRRMIY-UHFFFAOYSA-N
ID: 16443
SMILES:C(CC)CCCCc1cc(O)c(C2C(C(C)=C)CCC(C)C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.539
CB1 binding score: -14.382
InChIKey:BBUFUVZXSPLVAG-UHFFFAOYSA-N