ID: 50863
SMILES:O(c1c2c(cc(C)c1)OC(CCCC(=O)C)(C)CCC2C(C)(O)C)C(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -13.361
InChIKey:BHIOWWJKDCPAHA-UHFFFAOYSA-N
ID: 50864
SMILES:Oc1c2c(cc(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.766
InChIKey:GNBSKWGIRCMMKP-UHFFFAOYSA-N
ID: 50865
SMILES:CC1=CC(c2cc(OC)ccc2O)C(C(=C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.401
InChIKey:YRXZLRWBEYIBHE-UHFFFAOYSA-N
ID: 50866
SMILES:C1C(C)(O)C=CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.25
InChIKey:PGZISGZFEFJPOZ-UHFFFAOYSA-N
ID: 50867
SMILES:C1(C)=CC2C(CC1)C(C)(C)Oc1cc(C(C(C)C)=O)ccc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -14.07
InChIKey:YFZJCEZTUHRKIT-UHFFFAOYSA-N
ID: 50868
SMILES:Oc1cc(CCC)cc(O)c1C1CC(C)(O)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.888
InChIKey:XRVSXBLYAUVVFC-UHFFFAOYSA-N
ID: 50869
SMILES:C(C=O)C1C(C)(C)Oc2cc(CCCCC)c(C(OC)=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.412
CB1 binding score: -12.894
InChIKey:AXPPVSOPZATTCP-UHFFFAOYSA-N
ID: 50870
SMILES:C1=CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -14.23
InChIKey:XIJGJYYBUUPWNI-UHFFFAOYSA-N
ID: 50871
SMILES:C12(O)C(C)(CCCC1(C)C)Oc1c(c(OC)cc(CCCCC)c1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -15.306
InChIKey:HVDBGKLRPNBMKR-UHFFFAOYSA-N
ID: 50872
SMILES:c1(O)cc(CCC)cc2c1C1CC(C)(O2)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.301
InChIKey:SBPMGFIOIRMBJJ-UHFFFAOYSA-N
ID: 50873
SMILES:C(CCCc1cc2c(c(O)c1)C1C(CC=C(C)C1)C(=O)C2(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.096
InChIKey:FWRXCICBPBRXEZ-UHFFFAOYSA-N
ID: 50874
SMILES:C(=O)C1=C(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -14.041
InChIKey:LDLDMEARKQTDIH-UHFFFAOYSA-N
ID: 50875
SMILES:C12(C(C)(C)Oc3c(cc(O)cc3)C1)OC(CCCC(C)(O)C)(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.56
InChIKey:IQKNETOIUIULLE-UHFFFAOYSA-N
ID: 50876
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.832
InChIKey:LOUSQMWLMDHRIK-UHFFFAOYSA-N
ID: 50877
SMILES:O=C(Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -19.106
InChIKey:DEWSJDIJFWQLOA-UHFFFAOYSA-N
ID: 50878
SMILES:c1(C(CCCCCCC)CC=CC(CC)=O)cc(O)c(C2C=C(C)CCC2C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 454.695
CB1 binding score: -14.507
InChIKey:QKSYMDNKNAWHTN-UHFFFAOYSA-N
ID: 50879
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(C)CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -19.13
InChIKey:MFDMGSPYNZKQBC-UHFFFAOYSA-N
ID: 50880
SMILES:O=C1C(C)=C2C(C1=O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.408
CB1 binding score: -15.904
InChIKey:IYVOMXOSDTWKRF-UHFFFAOYSA-N
ID: 50881
SMILES:C1(C)=C2C(c3c(O)cc(CCCCC)cc3O)C(C)(C)C2CCC1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -13.339
InChIKey:QFKWIQILVDIXNA-UHFFFAOYSA-N
ID: 50882
SMILES:C1=CC(C)(C)Oc2cc(CCC)cc(O)c21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.296
CB1 binding score: -17.978
InChIKey:CHBXMMKWGIOKEK-UHFFFAOYSA-N
ID: 50883
SMILES:c1(CCCCC)c(O)c(C2C(C(C)=C)CCC(C)=C2)cc(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -17.027
InChIKey:BQNCLMCPDSYLAS-UHFFFAOYSA-N