ID: 93472
SMILES:O=C(C)OC1C23C(C)(CC4C(C1=C)c1c(cc(CC(O)C)cc1OC(=O)C)O4)OC(CCC=C(C)C)(C)C3C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.681
CB1 binding score: -15.862
InChIKey:OGHPMCVLGSJLTQ-UHFFFAOYSA-N
ID: 93473
SMILES:c1c(=O)cc2c(cc(OC)cc2C2CC(C)=CC(c3c(OC)ccc(CC[N+](O)(C)C)c3)C(C(C)=C)C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 528.713
CB1 binding score: -15.288
InChIKey:XTVOIDQENBUNKV-UHFFFAOYSA-N
ID: 93474
SMILES:c1c(CCC)c(O)c2c(c1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.438
InChIKey:ZSCKZFDBVKKURH-UHFFFAOYSA-N
ID: 93475
SMILES:C1(O)CC(C(=C)C)C(c2cc(CCN(C)C)ccc2OC)C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 329.484
CB1 binding score: -17.933
InChIKey:DOIPOJKBLDXMNY-UHFFFAOYSA-N
ID: 93476
SMILES:CCCCCc1cc2c(c3c1OC1(C)C(CCC(C)=C1)C3)OCO2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -12.848
InChIKey:ASVVZUOSROUWOS-UHFFFAOYSA-N
ID: 93477
SMILES:C12(C)Oc3c(c(OC(C)=O)cc(CCCCC)c3)CC1C(C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.016
InChIKey:HQFYFSGJCKQMNJ-UHFFFAOYSA-N
ID: 93478
SMILES:C1(=O)C2CC(COc3cc(CCCCCCC)ccc3)C3C(=O)CC2C3(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.663
CB1 binding score: -11.925
InChIKey:YTYCBACTXFLURZ-UHFFFAOYSA-N
ID: 93479
SMILES:C1(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 93480
SMILES:C1(CC=C(C)C)CCC(C)(C)Oc2c1c(O)cc(CCCCC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.336
InChIKey:XVXUUTWPMCAWRB-UHFFFAOYSA-N
ID: 93481
SMILES:CC1(C)C=CCC2(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -17.513
InChIKey:JNZAABMSKRVKJI-UHFFFAOYSA-N
ID: 93482
SMILES:c1(C)c(-c2c(CCCCC)cc3ccccc3c2)c2c(cc1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.67
CB1 binding score: -13.878
InChIKey:UVUPJAALGXWGJB-UHFFFAOYSA-N
ID: 93483
SMILES:C(CC)CCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 93484
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.697
InChIKey:RDLUNEDCJHKYDQ-UHFFFAOYSA-N
ID: 93485
SMILES:CC1=CC(c2c(O)cc(CCCCC)cc2O)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 93486
SMILES:Oc1c(C(C(=O)C(CC)C)C)c(O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.545
InChIKey:AWBDUAXUGBUKBC-UHFFFAOYSA-N
ID: 93487
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C(=O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.892
InChIKey:WBFVHFCVGUDTNV-UHFFFAOYSA-N
ID: 93488
SMILES:CC(C)=CCCC(C)=CCc1cc(O)cc(CC(OC)OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.633
InChIKey:WMGVPLZPFRBEEX-UHFFFAOYSA-N
ID: 93489
SMILES:C1C(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 93490
SMILES:COc1c(C2C(C(=C)C)CCC(C)=C2)c(OC(C)=O)cc(C(C)C)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.964
InChIKey:PNRJJUFVSGDRHE-UHFFFAOYSA-N
ID: 93491
SMILES:C(C)(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 93492
SMILES:Oc1c2c(c(CCC)cc1O)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.726
InChIKey:ZYNKSUAJWXETCB-UHFFFAOYSA-N