ID: 70645
SMILES:c1(C=O)c(O)c(C2C(C(C)=C)CCC(C)=C2)cc(C(C)=C)c1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -14.97
InChIKey:WNSPYQDTBQNEDH-UHFFFAOYSA-N
ID: 70646
SMILES:Oc1c(C(C(C)C)=O)c2c(c(O)c1)C1C(CC=C(C)C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -17.896
InChIKey:YAFMVAAAXLTYHW-UHFFFAOYSA-N
ID: 70647
SMILES:C(C(=CCc1c(O)c2c(c(C(C(CC)C)=O)c1O)OC(C)(C)C1C2C=C(C)CC1)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.689
CB1 binding score: -16.926
InChIKey:MPRCNESBZPLWJA-UHFFFAOYSA-N
ID: 70648
SMILES:C(CCC1(C)CCC2(c3c(cc(CCCCC)cc3O)OC2)CC1)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -14.468
InChIKey:IDLSUKAEZLKFCG-UHFFFAOYSA-N
ID: 70649
SMILES:C1C(C(O)(C)C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 264.365
CB1 binding score: -17.942
InChIKey:PRKDRANYBPHDBW-UHFFFAOYSA-N
ID: 70650
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 70651
SMILES:O1c2c(C(OC)=O)c(CCCCC)cc(OCC3=CCC(C(O)(C)C)OC3)c2C(c2c(O)c(C(=O)CCC)c(O)c(CCCC)c2)C1C=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 775.036
CB1 binding score: -12.626
InChIKey:FZLGIQPBTKVTSD-UHFFFAOYSA-N
ID: 70652
SMILES:C1(c2c(O)ccc(CCCCC)c2)CC(O)(C)C2CC(C)(C)C2CC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.08
InChIKey:CMDZYAIRMXFEIM-UHFFFAOYSA-N
ID: 70653
SMILES:CC1(C)C2CCC(C)=CC2c2c(c(OC(C(C)CC)=O)cc(COC(=O)C)c2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -15.929
InChIKey:VVQARHMIUVWWCK-UHFFFAOYSA-N
ID: 70654
SMILES:C1C(OC)Oc2cc(CCCCC)cc(O)c2C2C=C(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -13.423
InChIKey:CGKIEMQIQSNRBQ-UHFFFAOYSA-N
ID: 70655
SMILES:c1(O)cc(O)c(C2C(C(C)=C)CCC(C)=C2)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.957
InChIKey:ZSBGNUPOFUYDMQ-UHFFFAOYSA-N
ID: 70656
SMILES:CC(=O)Oc1cc(CCCCC)cc(OC(CCC=C(C)C)(C)C=C)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -11.749
InChIKey:GVSPEWSQAADEIT-UHFFFAOYSA-N
ID: 70657
SMILES:C1(C)(C)CC2C1c1c(cc(C(C)(C)CCCCCC)cc1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -16.943
InChIKey:WUKPTFMUMQRNNX-UHFFFAOYSA-N
ID: 70658
SMILES:CC1CCC(=C(C)C)C(c2cc(CCCCC)ccc2O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -15.929
InChIKey:MEKDDSZEXJVNIZ-UHFFFAOYSA-N
ID: 70659
SMILES:C1C(=C)C2C(C1)C(C)(C)Oc1cc(C(C)CC)c(O)c3c1C2C=C3C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 338.491
CB1 binding score: -16.27
InChIKey:SKKYQMCUFWIOLT-UHFFFAOYSA-N
ID: 70660
SMILES:c1(CCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCc2cc(O)c(C)c(C)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.501
CB1 binding score: -14.998
InChIKey:IBVZHRPXJJWWND-UHFFFAOYSA-N
ID: 70661
SMILES:CC1(C)Oc2cc(CCc3ccccc3)cc(O)c2C2CC(C)=CCC12
Pathway: Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 348.486
CB1 binding score: -17.817
InChIKey:AAVGZFGYDPFYEH-UHFFFAOYSA-N
ID: 70662
SMILES:c1c(O)cc(C)c(-c2oc(=O)c3c(c2)OC(C)(C)C2C3CC(C)=CC2)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 352.43
CB1 binding score: -15.929
InChIKey:BSRQYKYHTVTIDZ-UHFFFAOYSA-N
ID: 70663
SMILES:C1CC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 70664
SMILES:C12CC(O)C(=C)CCC1C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.217
InChIKey:HTXYQUMFRCJZTN-UHFFFAOYSA-N
ID: 70665
SMILES:CC(CCC=C(C)C)(C=C)CC1c2c(O)cc(CCCCC)cc2OC1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -13.28
InChIKey:HWTPTZUGVJRBNJ-UHFFFAOYSA-N