ID: 108991
SMILES:c1c(O)c(C2C=C(C)CCC2C(C)=C)cc(C(=O)OC)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.003
InChIKey:VPSWYBOTFPOXLO-UHFFFAOYSA-N
ID: 108992
SMILES:C(CCCC)c1cc(O)c2c(c1O)C=CC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.339
InChIKey:DPWWYSVEFIPIFU-UHFFFAOYSA-N
ID: 108993
SMILES:C(c1cc(OC)c(O)c2c1OC(C)(C)C1C2CC(CO)=CC1)CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.605
InChIKey:BYSRRGGICZLNGF-UHFFFAOYSA-N
ID: 108994
SMILES:O1C2C3C(COC(=O)C)(CO)CCCC3(C)C2C(O)c2c(O)cc(CCCCC)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 432.557
CB1 binding score: -14.742
InChIKey:KFYWIFKXMFURKE-UHFFFAOYSA-N
ID: 108995
SMILES:c1(CC(C)O)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -17.582
InChIKey:RYBCXAHJHZXWFZ-UHFFFAOYSA-N
ID: 108996
SMILES:c1(O)ccc(C2C(C)(CCc3c(O)c(C)cc(O)c3)C(C(C)=C)CC3C(C)(O)CCCC3=C2)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 476.657
CB1 binding score: -15.425
InChIKey:QDPNHIQLYYPBDA-UHFFFAOYSA-N
ID: 108997
SMILES:C(C)CCCc1c2c(ccc1C)C1C(C(C)(C)Oc3cc(C)c(O)cc3C1=O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -13.033
InChIKey:ZTHGWMWXCCYICS-UHFFFAOYSA-N
ID: 108998
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C=C(C)CCC2C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.523
InChIKey:NIBMZWXYVNTLQQ-UHFFFAOYSA-N
ID: 108999
SMILES:C1C(C)=CC(c2c(O)cc(C=Cc3cc(CCCCC)cc(O)c3)cc2O)C(C(C)=C)C1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 432.604
CB1 binding score: -14.499
InChIKey:OJWIGEUVZFKFDT-UHFFFAOYSA-N
ID: 109000
SMILES:CC1=CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 109001
SMILES:O(c1c(OCC=C(CCC=C(CCC=C(C)C)C)C)c(OC)cc(CCN(C)C)c1)C1C=C(C)CCC1C(C)=C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 549.84
CB1 binding score: -15.19
InChIKey:JMAPKYPZKUSZBT-UHFFFAOYSA-N
ID: 109002
SMILES:c1(O)ccc(O)cc1C1Oc2cc(CCCCC)cc(O)c2C(O)C1C(=CCC=C(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 452.591
CB1 binding score: -15.044
InChIKey:YHDIQJFYRZPWJK-UHFFFAOYSA-N
ID: 109003
SMILES:CC(OCC(C(c1cc(O)c2c(c1)OC(C)(C)C=C2)CCC=C(C)C)=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.447
InChIKey:DKZGUBBVQMQRMH-UHFFFAOYSA-N
ID: 109004
SMILES:C(C)(C)=C1C(=O)CC(C)CCCC2(C)Oc3c(c(O)cc(CCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -14.263
InChIKey:KGLBGZZTMPCAHQ-UHFFFAOYSA-N
ID: 109005
SMILES:CC1(C)C(O)CCC(C=O)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -14.083
InChIKey:BEJLIGUTVUDPOR-UHFFFAOYSA-N
ID: 109006
SMILES:O1c2cc(CCCCC)c(C(OC)=O)c(O)c2C(=O)C2C(C)(C)CCCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -15.342
InChIKey:RCXONCUFUKNDJC-UHFFFAOYSA-N
ID: 109007
SMILES:C1(c2ccc(O)cc2)Oc2c(cc(CCCCC)cc2O)CC1C(C)=CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 420.593
CB1 binding score: -15.548
InChIKey:QVQJYBCGICPTPS-UHFFFAOYSA-N
ID: 109008
SMILES:C(C(c1c(O)c2c(cc1C)OC(C)(C)C1C2C=C(C)CC1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -15.739
InChIKey:BKAPZASUPWOLSZ-UHFFFAOYSA-N
ID: 109009
SMILES:CC(=O)OCc1cc(O)c(CC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.413
CB1 binding score: -18.471
InChIKey:GXTVPSQVRXITHS-UHFFFAOYSA-N
ID: 109010
SMILES:C(=C(C)C)CCC(=CCc1cc(OC(C)=O)c(C2C(C(C)=C)CCC(C)=C2)c(OC(=O)C)c1OC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -16.633
InChIKey:KMAWYAHHJRNKSE-UHFFFAOYSA-N
ID: 109011
SMILES:CC1(C)Oc2cc(CCCC(=C)C)ccc2CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.378
CB1 binding score: -17.241
InChIKey:ZXSROAAGWSYILP-UHFFFAOYSA-N