ID: 81985
SMILES:c1(C(CCCCCC)C)cc(C(=O)O)c(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -14.022
InChIKey:QKZMYXNHJOCZRU-UHFFFAOYSA-N
ID: 81986
SMILES:C(Cc1cc(C2C=C(C)CCC2C(=C)C)c(O)c(C=O)c1O)(=O)OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -13.339
InChIKey:IFXHPLFWWVGYPM-UHFFFAOYSA-N
ID: 81987
SMILES:C(c1c(O)c2c(cc1CCCCC)OC(C)(C)C1C(C=C(C)CC1)C2)(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -14.814
InChIKey:YSPQKICPDUDRKW-UHFFFAOYSA-N
ID: 81988
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.166
InChIKey:FGEQAFJXCIBXCD-UHFFFAOYSA-N
ID: 81989
SMILES:c1(CC(OC)OC)cc(O)c2c(c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -13.418
InChIKey:CAOADGJKXHIIQL-UHFFFAOYSA-N
ID: 81990
SMILES:CC1(C)C2C(C)(CC(=O)C1)Oc1c(c(O)cc(CCCCCC)c1)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -15.269
InChIKey:OIBGPOSTOSJDDK-UHFFFAOYSA-N
ID: 81991
SMILES:CC(=CCCC(C)=CCCC(C)=CCc1c(O)cc(CCc2ccc(O)cc2)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -19.427
InChIKey:VVBVATXKSUVSTB-UHFFFAOYSA-N
ID: 81992
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)cc(C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 81993
SMILES:CC(CCC=C(C)C)=CCc1cc(OC(C)=O)c(C)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -18.803
InChIKey:PEAVXEHUMHXIHB-UHFFFAOYSA-N
ID: 81994
SMILES:c12c(OC)cc(CCCCC)cc1OC1C(C(C)C)CCC(CO)=C21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.118
InChIKey:UILNIVRKKQJTOT-UHFFFAOYSA-N
ID: 81995
SMILES:C1COc2cnc(CCCCC)c(C3C=C(C)CCC3C(C)=C)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 325.496
CB1 binding score: -15.62
InChIKey:IUFJPKZMTYZRKV-UHFFFAOYSA-N
ID: 81996
SMILES:C(CCCc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N
ID: 81997
SMILES:c1c(C)c(-c2c(C)cc(OI)c(C(C)C)c2)c(O)c2c1OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.462
CB1 binding score: -13.951
InChIKey:CGXQBZIJPBLKPO-UHFFFAOYSA-N
ID: 81998
SMILES:O(C=C(C=C)C)c1cc2c(c(O)c1)C1C(CCC(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -12.986
InChIKey:WSVPUVOTOIHMTG-UHFFFAOYSA-N
ID: 81999
SMILES:CC1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 82000
SMILES:Oc1c(C(C(C)CC)=O)c(O)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.563
InChIKey:KFHWFLUEGBMEIL-UHFFFAOYSA-N
ID: 82001
SMILES:CC1=CC(c2c(OC)ccc(CCN(C)C)c2)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 313.485
CB1 binding score: -18.294
InChIKey:GJDVDGGMUGCJGX-UHFFFAOYSA-N
ID: 82002
SMILES:C1C(C)=CCC(C(C)C)C2c3c(O)cc(CCCCC)cc3OC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -18.283
InChIKey:VYZZEHJOPXBTCY-UHFFFAOYSA-N
ID: 82003
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C)(C1)CCC(C(C)(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.237
InChIKey:LSOBGMGWNUWHQU-UHFFFAOYSA-N
ID: 82004
SMILES:Oc1cc2c3c(c1)C(=O)OC(C)(C)C1CCC(C)(C1Cc1c(O)cc(CCCCC)cc1O2)O3
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -16.749
InChIKey:SBYCIQHJXCGRHC-UHFFFAOYSA-N
ID: 82005
SMILES:CC(=C)C1C(c2c(O)cc(CCCCC)cc2O)C(O)C(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.224
InChIKey:FTRRSPPOMZCCCX-UHFFFAOYSA-N