ID: 41875
SMILES:C1C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2O)C2C(C)(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.22
InChIKey:MNUCPXKIRZXTGX-UHFFFAOYSA-N
ID: 41876
SMILES:c1(CCCCCC)c(C)c2c(cc1C)OC(C)(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Prenyl quinone meroterpenoids
MW: 274.448
CB1 binding score: -15.369
InChIKey:KWSXVSZLPYLQEH-UHFFFAOYSA-N
ID: 41877
SMILES:C=C(C1C(c2c(O)cc(CCCCC)cc2O)CC(C)(O)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -18.306
InChIKey:SCWSGMRHTABSRY-UHFFFAOYSA-N
ID: 41878
SMILES:C1C(C)(C)C2C(c3c(cc(CCCCC)cc3O)O2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -16.329
InChIKey:NPGPTSSHYPTWND-UHFFFAOYSA-N
ID: 41879
SMILES:OC1C(O)C(O)C(Oc2c(CCCC)cc3c(c2O)C2C(CCC(C)=C2)C(C)(C)O3)OC1CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 478.582
CB1 binding score: -16.502
InChIKey:NDMIRIGSVWXODS-UHFFFAOYSA-N
ID: 41880
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(CCC(O)=O)cc(C(=O)CCCOC)c3C(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.184
InChIKey:XMMPDMXYWFTMGF-UHFFFAOYSA-N
ID: 41881
SMILES:C1(=O)C(C)(C)C2(Oc3c(c(O)cc(CCC)c3)C2)C2=C(C(C)(C)CCC2)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.517
CB1 binding score: -14.551
InChIKey:HLLMVWMWLGGHAF-UHFFFAOYSA-N
ID: 41882
SMILES:OC1C=C(CCc2c(C)cc(O)cc2C)CCC1=C(C)C=CC(O)(C)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -16.488
InChIKey:IXYBBGUUYLGBJP-UHFFFAOYSA-N
ID: 41883
SMILES:CC(=CCCC1(C)Oc2cc(C)cc(O)c2CC1C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -19.203
InChIKey:JHQKHQGVDMMGDS-UHFFFAOYSA-N
ID: 41884
SMILES:C(C1=CC2C(C(C)(C)Oc3c1c(=O)c(CC(=C)CCc1c(O)cc(CCCCC)cc1O)c3C)CC2)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.749
CB1 binding score: -15.708
InChIKey:AOGCJTCNORPQLC-UHFFFAOYSA-N
ID: 41885
SMILES:Cc1cc(O)cc(CCc2c(O)c(C(C3C(C(O)(C)CCC=C(C)C)CC(C(=C)C)C3)=O)c(O)cc2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -16.23
InChIKey:JCDKQEOPIWNQCN-UHFFFAOYSA-N
ID: 41886
SMILES:CCCCc1cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -18.265
InChIKey:KTPDAZGMXXWSMU-UHFFFAOYSA-N
ID: 41887
SMILES:C1=C(CO)CCC2C(C)(C)Oc3c(cc(CCCCC)c(OC(C)=O)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.297
InChIKey:CENYOLAHQCTSCO-UHFFFAOYSA-N
ID: 41888
SMILES:c12cc(O)c(C)cc1OC(c1ccc(OC)cc1)(C(=O)C(C)CC)C(Oc1cc(CCCCC)cc3c1CO3)-2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 530.661
CB1 binding score: -15.511
InChIKey:ZACLKXUXINXGAE-UHFFFAOYSA-N
ID: 41889
SMILES:C1(=O)C(C)=CCC(C(C)=C)C1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -17.022
InChIKey:UYOANWRMMVHFJS-UHFFFAOYSA-N
ID: 41890
SMILES:COc1cc2c(cc1CCCCC)OC(C)(C)C1=C(C2=O)C(C)C2OC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -16.367
InChIKey:IYOKXYGYLMAVLQ-UHFFFAOYSA-N
ID: 41891
SMILES:CC(=CCc1c(O)cc(CC)cc1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.374
InChIKey:FYEVCSFOWVVFOK-UHFFFAOYSA-N
ID: 41892
SMILES:O1c2c(c(O)cc(CCCCC)c2)C(=O)C12C1CC(C(C)C)C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 382.544
CB1 binding score: -14.62
InChIKey:WFJVILMENIUHIE-UHFFFAOYSA-N
ID: 41893
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC(C(O)(C)C)CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.592
CB1 binding score: -16.336
InChIKey:YHADLXDJQAMGRG-UHFFFAOYSA-N
ID: 41894
SMILES:c1(O)cc(CCCCC)cc2c1C1C=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: 41895
SMILES:C1(CCC)C(C)CCC2C(C)(C)Oc3cccc(C)c3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: Not available
InChIKey:QTLYZWSLBGLXPM-UHFFFAOYSA-N