ID: 32929
SMILES:CC(C)=CCc1c(O)c(C2COc3cc(O)cc(CCCCC)c3)c2OC2C1(O)C(O)C(O)C(C)(CO)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 532.63
CB1 binding score: -12.683
InChIKey:HEUTZEAKWLBWHN-UHFFFAOYSA-N
ID: 32930
SMILES:C1(c2c(O)cc(CCCCC)c(C(=O)O)c2O)CC(C)=CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.459
InChIKey:VSGIZLVGESQNDC-UHFFFAOYSA-N
ID: 32931
SMILES:CC(CCC=C(C)C)=CCCC(C)=CCc1c(O)cc(CCc2ccccc2)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 418.621
CB1 binding score: -19.13
InChIKey:IWSASXREQYAISF-UHFFFAOYSA-N
ID: 32932
SMILES:c1(O)c2c(cc(CCCC(C)O)c1O)OC(C)(C)C(CC=C(C)CCCC(C)(O)C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.617
CB1 binding score: -14.154
InChIKey:YCDOCZBTAOIZJR-UHFFFAOYSA-N
ID: 32933
SMILES:C(=CC(C(C)C)CCO)c1c(C)cc2c(c1OC)CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -12.167
InChIKey:RKMAARMRBYYSQC-UHFFFAOYSA-N
ID: 32934
SMILES:c1c(C(O)(CCCC(C)C)C)c(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.389
InChIKey:ZCUQOASTQIDXIL-UHFFFAOYSA-N
ID: 32935
SMILES:C(CCc1cc(O)c2c(c1O)OC(C)(C)C1=C2CC(C)CC1)=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.903
InChIKey:HOMXNPIWOVMDPB-UHFFFAOYSA-N
ID: 32936
SMILES:C(C)(C)(OO)C=CCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -14.836
InChIKey:IPIDWECPLCCHLT-UHFFFAOYSA-N
ID: 32937
SMILES:C1(O)(C)CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -20.807
InChIKey:KSGRDIFQZVURIF-UHFFFAOYSA-N
ID: 32938
SMILES:C1(OC(=O)C(=CC)C)C2c3c(cc(C)c(O)c3)OC(C)(C)C2CC=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.462
CB1 binding score: -13.705
InChIKey:GVGUENUNKNOZDJ-UHFFFAOYSA-N
ID: 32939
SMILES:C(CCc1c(O)cc(O)c2c1OC2(C)CCC=C(C)C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -14.816
InChIKey:RUJBZUKJFGCGLJ-UHFFFAOYSA-N
ID: 32940
SMILES:CC1(C)Oc2cc(CCCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 32941
SMILES:c1(C(=O)O)c(CCCCC)cc2c(c1O)C1C=C(C(=O)O)CCC1C(CO)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.459
CB1 binding score: -15.555
InChIKey:SSUINHTZNDKPLH-UHFFFAOYSA-N
ID: 32942
SMILES:C12C(C)(Oc3cc(O)cc(CCCCC)c31)CCC(O)C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.457
CB1 binding score: -14.24
InChIKey:UCWGFXBEOMZYDJ-UHFFFAOYSA-N
ID: 32943
SMILES:c1(O)cc(O)c2c(c1)C1CC(C)=CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -17.624
InChIKey:ZZWZWPVQXHMOQM-UHFFFAOYSA-N
ID: 32944
SMILES:C(C)(C1C(c2c(O)cc(CCCCC)cc2)C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.957
InChIKey:XFYKOYWZVVGAEV-UHFFFAOYSA-N
ID: 32945
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(O)(C)C)CCC1(C)CC2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.773
InChIKey:MNPGMCYGHMYWDA-UHFFFAOYSA-N
ID: 32946
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.524
InChIKey:USODFRMMCODFKQ-UHFFFAOYSA-N
ID: 32947
SMILES:C12c3c(cc(CCCC(O)C)c(C=O)c3O)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -16.631
InChIKey:XIROAMUARFVUBR-UHFFFAOYSA-N
ID: 32948
SMILES:C=C(C)C1CCC(C(CCC2(C)Oc3cc(CCCCC)cc(O)c3C=C2O)=O)OC1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -15.981
InChIKey:NKADUTUAHCBWBT-UHFFFAOYSA-N
ID: 32949
SMILES:Oc1c2c(c(C=O)c(CCCCC)c1)OC(C)(C)C1CC=C(CO)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.471
InChIKey:HGWRLOBHQVCWOA-UHFFFAOYSA-N