ID: 136270
SMILES:O=C(C(C)(CC1=C(C)CC2CC(C)(C)Oc3c2c(cc(C)c31)O)OC)O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.876
InChIKey:FWEHXMZFPHZFSQ-UHFFFAOYSA-N
ID: 136271
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C13C1C(CC=C(C)C1C2)C(OC)(C)CC3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 438.652
CB1 binding score: -13.467
InChIKey:KCDNXKBDPPAOLG-UHFFFAOYSA-N
ID: 136272
SMILES:CC(C1C2(C)C(C)=CCC=C2CCC1)=CCc1c(O)ccc(OS(=O)(O)=O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.528
CB1 binding score: -14.569
InChIKey:KETSXOBEKIRKQZ-UHFFFAOYSA-N
ID: 136273
SMILES:C1(C)(C)C2CC=C(C(=O)O)CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 136274
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.666
InChIKey:QXACEHWTBCFNSA-UHFFFAOYSA-N
ID: 136275
SMILES:c12cc(CCCCC)cc(O)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 136276
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C(C)CCC2C(C)(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.502
InChIKey:FCOLXXAFSXUTRY-UHFFFAOYSA-N
ID: 136277
SMILES:c1(O)cc(CCCC)ccc1CC=C(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 218.34
CB1 binding score: -17.943
InChIKey:UEQAHUMIVHTIOB-UHFFFAOYSA-N
ID: 136278
SMILES:C(=O)(OC(C(C)C)C(c1cc(O)c2c(c1)OC1(C)CCCC(C)(C)C1C2)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.548
CB1 binding score: -14.109
InChIKey:DLIGGVUMUBAOAM-UHFFFAOYSA-N
ID: 136279
SMILES:C(CO)Cc1cc(O)c(CC=C(CCC=C([CH]CC=C(C)C)C)C)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 385.568
CB1 binding score: -15.071
InChIKey:QXLWFDQAIHXNAN-UHFFFAOYSA-N
ID: 136280
SMILES:C(CCC)c1cc2c(c(O)c1)C1C(CCC(C)(O)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -18.488
InChIKey:SHKSNSDRGOBIPR-UHFFFAOYSA-N
ID: 136281
SMILES:C12=C(OC(C)(C)CC1)C(CC(C)=C)c1c(c(O)cc(CCCCC)c1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.504
InChIKey:PPLPHCKJPRVTIH-UHFFFAOYSA-N
ID: 136282
SMILES:C(C)(C1=CC(C(C)=C)C(c2cc(CCCC)ccc2O)C=C(C)C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.535
CB1 binding score: -14.934
InChIKey:MPMDLVNGKUFAJG-UHFFFAOYSA-N
ID: 136283
SMILES:Oc1c(C2C(C(C)=C)CCC(C)=C2)c(O)c(C=O)c(OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.235
InChIKey:UIHWKLOPDYVYQF-UHFFFAOYSA-N
ID: 136284
SMILES:c1c(C2CCC(C)(C)OC2=O)c(Br)c(C)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.218
CB1 binding score: -14.054
InChIKey:DWBUDSITDQLWIB-UHFFFAOYSA-N
ID: 136285
SMILES:CC(CCCC(C)C)=CCCC(C)(O)C1Oc2cc(CCCCCC)cc(O)c2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.646
CB1 binding score: -14.109
InChIKey:NOGARINRGVIWQP-UHFFFAOYSA-N
ID: 136286
SMILES:CC1(CCC=C(COC(=O)C)C)C2CCC(C(=O)OC)=CC2c2c(cc(CCCCO)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.605
CB1 binding score: -14.471
InChIKey:WKDCFZKUHQCXFL-UHFFFAOYSA-N
ID: 136287
SMILES:OC(C)(C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 136288
SMILES:OC1CCC(C)=CC2c3c(cc(CC=C(C)C)c(C(=O)CN4CCCC4C=O)c3OC)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 495.66
CB1 binding score: -13.077
InChIKey:YSIQUXXBILHILY-UHFFFAOYSA-N
ID: 136289
SMILES:O1CC(CC2(C)C=Cc3cc(O)cc(C)c3OC2(C)C)=CC1(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.482
InChIKey:YLRBMFLWWWQFSM-UHFFFAOYSA-N
ID: 136290
SMILES:C1C2=C(OCC1C)c1c(cc(CCCCC)cc1O)OC1(C)CCC(C(OCC)(C)C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -16.042
InChIKey:LFYPTYXXDKYOQJ-UHFFFAOYSA-N