ID: 72031
SMILES:C1(C)(C)C2(CO)CCC3(C1CC2)Oc1c(c(O)cc(CCCCC)c1)C3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.582
InChIKey:JESOHQZTFPNKKR-UHFFFAOYSA-N
ID: 72032
SMILES:CC(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.375
CB1 binding score: -19.394
InChIKey:IQDBYPKRWVDTCI-UHFFFAOYSA-N
ID: 72033
SMILES:CC(=CCc1c(OC)cc(CCCCC)c(C(=O)O)c1O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -18.336
InChIKey:UJSSSFNGQWZNEN-UHFFFAOYSA-N
ID: 72034
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -17.085
InChIKey:VUDSKIPMWGVGSR-UHFFFAOYSA-N
ID: 72035
SMILES:C(c1cc(CC2CC(C(C)(O)C)OC2(C)C)c(O)c(C2C=C(C)CCC2C(=C)C)c1)(O)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -14.974
InChIKey:LWRXMFQHIUXURZ-UHFFFAOYSA-N
ID: 72036
SMILES:O1C2C(OC3=C(C1(O)C)CC(C)C(C=O)C3)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -17.031
InChIKey:WJKNKTRRBJIQLY-UHFFFAOYSA-N
ID: 72037
SMILES:C(CCCCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 72038
SMILES:c1(CCCCC)cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 72039
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC1(C)C3CCC(CO)C13C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -14.641
InChIKey:BYQAUAZYDYGCJR-UHFFFAOYSA-N
ID: 72040
SMILES:c1(C)c(OC)cc(OC)c2c1C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.53
InChIKey:YQCFTKAEAJCFFT-UHFFFAOYSA-N
ID: 72041
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 72042
SMILES:c1(CCC)cc2c(c(O)c1)C1C(C(C)(OCC=C)C)CCC(C)(O1)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -13.906
InChIKey:HOXUQISPUBWSAM-UHFFFAOYSA-N
ID: 72043
SMILES:C(C)CCc1cc2c(c(O)c1)C1C(C(C)=C)CCC3(C)C1(O2)CCC3C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -13.872
InChIKey:QTZWWIJRTMZPNC-UHFFFAOYSA-N
ID: 72044
SMILES:C1C2C(C)(C)OC3c4c(cc(CCCCC)cc4O)OC(C)(CC2)C13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.605
InChIKey:KOZCPOPCFARMQR-UHFFFAOYSA-N
ID: 72045
SMILES:C(Cc1cc(O)c(CC=C(CCCC(C)C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.501
CB1 binding score: -17.054
InChIKey:YDEZBLGFVPGHEB-UHFFFAOYSA-N
ID: 72046
SMILES:c12c(O)cc(CCCCC)cc1OC(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: 72047
SMILES:O(c1c(CC=C(C)C)c(O)cc2c1-c1c(ccc(C)c1)C(C)(C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.447
CB1 binding score: -16.512
InChIKey:VGZWCKIKLZYIHD-UHFFFAOYSA-N
ID: 72048
SMILES:C(CCCc1cc2c(c(OC)c1)OCO2)C1(C)CCC(C(C)(O)C)O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 350.455
CB1 binding score: -14.147
InChIKey:OBGLGSMEKMIRBW-UHFFFAOYSA-N
ID: 72049
SMILES:C1CC(C)=CC2c3c(cc(CCCCC)c(C(=O)O)c3O)OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 72050
SMILES:CC1CCC(C(C)C)C(c2c(O)cc(CCCCC)cc2O)C1OC(C(=CC)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.748
InChIKey:ROCDBJORMJILNA-UHFFFAOYSA-N
ID: 72051
SMILES:c1(CCO)c(C)cc2c(c1O)C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -16.174
InChIKey:PUMWKVQSCVWJJP-UHFFFAOYSA-N