ID: 116719
SMILES:C1(C(O)(C)C)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.812
InChIKey:FTDORWGKHUOHKJ-UHFFFAOYSA-N
ID: 116720
SMILES:C(C)CCc1cc(O)c2c(c1)OC(C)(C)C1C(O)C3C(C)(CCCC32C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -13.522
InChIKey:DYZOPFPIJOAPPT-UHFFFAOYSA-N
ID: 116721
SMILES:CC1(C)Oc2cc(CCc3ccccc3)cc(O)c2C2C=C(C)CCC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.486
CB1 binding score: -19.258
InChIKey:DYHMKBLKWFFFSZ-UHFFFAOYSA-N
ID: 116722
SMILES:CC1=CC2(O)C(C(C)(C)Oc3cc(CCCCCC)cc(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.892
InChIKey:YEIFCHJUZKQODK-UHFFFAOYSA-N
ID: 116723
SMILES:c1(O)c2c(c(O)cc1CCCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.339
InChIKey:DPWWYSVEFIPIFU-UHFFFAOYSA-N
ID: 116724
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2CC(=C)C3CCC(C)(C)C3(O)CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.515
InChIKey:DPJONEAEDOFQQI-UHFFFAOYSA-N
ID: 116725
SMILES:c12c(cc(COC)cc1O)C=CC(CCC=C(C)C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -16.278
InChIKey:UNESBYOODLTYAX-UHFFFAOYSA-N
ID: 116726
SMILES:c12cc(CCCC(CCC=C(C)C)=C)cc(O)c1C=CC(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -14.156
InChIKey:XETXYXGMGZBVFK-UHFFFAOYSA-N
ID: 116727
SMILES:CC(OC(C)(C)C#CC1C2C(CC(C)=CC2)c2c(oc3c2cccc3)O1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.512
CB1 binding score: -17.149
InChIKey:OZRVDPIUMZLIIL-UHFFFAOYSA-N
ID: 116728
SMILES:C1=C(C)CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 116729
SMILES:C1C(C)=CC2c3c(O)cc(CCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 116730
SMILES:c1cc2c(cc1CCCCC)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.334
InChIKey:GKTLMTLABYYGES-UHFFFAOYSA-N
ID: 116731
SMILES:CCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 116732
SMILES:O=C(CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CCC=Cc1cc(O)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 462.586
CB1 binding score: -14.663
InChIKey:NNCJAXQOVLCWQO-UHFFFAOYSA-N
ID: 116733
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(C)O2)CC=C(COC)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.12
InChIKey:GVXOGWYMXBHGGJ-UHFFFAOYSA-N
ID: 116734
SMILES:Oc1c(C)c(C2C=C(C)CCC2C(=C)C)c(O)cc1OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -17.036
InChIKey:VJVSAUGSVUDPEW-UHFFFAOYSA-N
ID: 116735
SMILES:C1C(C(=C)C)C(c2c(O)ccc(CCCCC)c2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 116736
SMILES:C(c1c(O)c2c(cc1)OC(C)(C)C1=C2C=C(C)CC1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -15.156
InChIKey:WYIDXIBPDWISRI-UHFFFAOYSA-N
ID: 116737
SMILES:c1(O)cc(CCCCC)cc2c1C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 116738
SMILES:C12=C(CCC(O)(C)C1)C(C)(C)Oc1c-2cc(CCC(C(C)(O)C)=C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -16.394
InChIKey:YISVFWJIYLGKQW-UHFFFAOYSA-N
ID: 116739
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)CC(C)=CCc1c(=O)oc2c(cccc2O)c1O
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 516.634
CB1 binding score: -12.771
InChIKey:ZWQCYEKHXNZLBC-UHFFFAOYSA-N