ID: 137992
SMILES:CC1CCC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 137993
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1=C2CC(C(=O)OC)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.595
InChIKey:GZYCMEKTQYEREW-UHFFFAOYSA-N
ID: 137994
SMILES:C(CCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)(C)(C)O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -16.875
InChIKey:KQFRGHZJLFMTFT-UHFFFAOYSA-N
ID: 137995
SMILES:C1(C)CCC2C(C)(C)Oc3cc(C)cc(O)c3C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -18.57
InChIKey:JWVNDMUNWMFDDK-UHFFFAOYSA-N
ID: 137996
SMILES:CC1(OC(C)=O)C(c2c(OC)cc(CCCCC)cc2OC(C)(C)C)OC12C1CCCC1(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.693
CB1 binding score: -16.083
InChIKey:PUYPNRPNAZOKLB-UHFFFAOYSA-N
ID: 137997
SMILES:C(=C(C)C=O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.409
CB1 binding score: -15.106
InChIKey:OUSQLNZBBRRODN-UHFFFAOYSA-N
ID: 137998
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC2(C)C2CC(C)(C)CC2C1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -15.477
InChIKey:IMVSTEYLBNZELM-UHFFFAOYSA-N
ID: 137999
SMILES:C1(=O)C2OC2(C)C2(O)C1C(C(C)(O)C)Cc1c(O)cc(CCCCC)cc12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -16.44
InChIKey:ZHXJVPPBBNMOLC-UHFFFAOYSA-N
ID: 138000
SMILES:Oc1cc(CCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 138001
SMILES:C1(C)(C)Oc2c(c(O)cc(CCC)c2)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.321
InChIKey:ZROLHBHDLIHEMS-UHFFFAOYSA-N
ID: 138002
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.072
InChIKey:DJCKLUPKZRLTPE-UHFFFAOYSA-N
ID: 138003
SMILES:C(c1cc(O)c(C2C=C(C)CCC2C(=O)C)c(O)c1)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.938
InChIKey:KDWGKPUANATKQU-UHFFFAOYSA-N
ID: 138004
SMILES:c12c(O)c(C)ccc1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -17.784
InChIKey:LLVFACSDBUCYNI-UHFFFAOYSA-N
ID: 138005
SMILES:c1(C(=O)C)cc(OC)c(C2C=C(C)C(O)CC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -14.605
InChIKey:BWGWDYLGZMECNR-UHFFFAOYSA-N
ID: 138006
SMILES:C1=CC(C)c2c3c(c(OC)c(OC)c21)C1C=C(C)CC(OC(C)=O)C1C(C)(C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.499
CB1 binding score: -13.678
InChIKey:SLRHRNCGHCENTJ-UHFFFAOYSA-N
ID: 138007
SMILES:c1(CCCCC)cc(O)c2c(c1)OC1(C)CC(OC(C(F)(C)C)=O)C(C(C)(C)O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.564
CB1 binding score: -14.969
InChIKey:PKZFDFOIDUKOLC-UHFFFAOYSA-N
ID: 138008
SMILES:Oc1cc(C)ccc1C1(C)Oc2c(cc(CCCCC)c(C(O)=O)c2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.473
CB1 binding score: -13.916
InChIKey:MFDGIRRUMHYPFP-UHFFFAOYSA-N
ID: 138009
SMILES:C1(=O)C=C(C)C2C1C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.502
InChIKey:PQRKFQTZXICNQV-UHFFFAOYSA-N
ID: 138010
SMILES:CC(=CCCC(=CCc1c(O)cc(COC2C(O)C(O)C(O)C(CO)O2)cc1O)C)C#CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 502.604
CB1 binding score: -14.605
InChIKey:HYVRHXFBVKMUHE-UHFFFAOYSA-N
ID: 138011
SMILES:CC1(C)C2CC1c1c(cc(CCCCC)cc1O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -17.462
InChIKey:HJWJCNXNJSEPPC-UHFFFAOYSA-N
ID: 138012
SMILES:C1=CC(C)(O)CCC1c1c(O)cc(CCCCC)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.736
InChIKey:IQCZKCACQOMRRA-UHFFFAOYSA-N