ID: 98575
SMILES:O=C1c2c(cc(CCCCC)c(C(O)=O)c2O)OC(CO)C1(CCC=C(C)C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.503
CB1 binding score: -16.998
InChIKey:GOLBQLMRHIJDNZ-UHFFFAOYSA-N
ID: 98576
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C(=O)O)CCC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.38
CB1 binding score: -15.871
InChIKey:GFIMROBTQLDYPN-UHFFFAOYSA-N
ID: 98577
SMILES:c1(C(C)(CCCC(C)C)O)cc2c3c(c(O)c(CC=C(C)C)c2O)OC(C)(C)C1C3
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.586
CB1 binding score: -15.111
InChIKey:JPKQHRPRIZMMNS-UHFFFAOYSA-N
ID: 98578
SMILES:O1c2cc(CCCC)cc(O)c2C2C(CC=C1C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.719
InChIKey:SHPSRTWDLRJRSV-UHFFFAOYSA-N
ID: 98579
SMILES:C(Cc1cc2c(c(O)c1)C1C(C(=C)C)CCC2(C)O1)(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.655
InChIKey:QFNGJRBABPOQFY-UHFFFAOYSA-N
ID: 98580
SMILES:C1(C)(O)CCC2C(C)=CCC(C(=C)C)C1c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.56
CB1 binding score: -15.638
InChIKey:LFHCOYUWWBQTER-UHFFFAOYSA-N
ID: 98581
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 312.453
CB1 binding score: -18.585
InChIKey:HVEYNLWUTOKMJT-UHFFFAOYSA-N
ID: 98582
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 98583
SMILES:C1(C)(OC)C(O)CCC(=C)C2C(CC1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.562
InChIKey:SPVDHERXUBEZPR-UHFFFAOYSA-N
ID: 98584
SMILES:C12C(C)(C)CCCC1(C)Oc1cc(CCCCC)cc(O)c1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -18.783
InChIKey:KPTGTVLDBMVBEX-UHFFFAOYSA-N
ID: 98585
SMILES:CC12OC1C1c3c(cc(CCCCC)cc3O)OC(C)(C)C1CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.791
InChIKey:VSQGBNUBIDZRPJ-UHFFFAOYSA-N
ID: 98586
SMILES:c1(C)c(CCCCC)cc(O)c2c1OC1C(C(C)C)C3C(C)(CCC1C(C)(C)O2)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -14.252
InChIKey:SZBZEDRNJZYZHJ-UHFFFAOYSA-N
ID: 98587
SMILES:C12=C(C)CCC(C1O)C(C)CCC1C2C=C(C)CCC2C(C)(Oc3c1c(O)cc(C)c32)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -15.552
InChIKey:HRAPYTWSEJGGTR-UHFFFAOYSA-N
ID: 98588
SMILES:C1(Cc2c(O)cc(CCCCC)c(C(O)=O)c2O)=C(C)CCCC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.687
InChIKey:BJWCRDJCYAIXFD-UHFFFAOYSA-N
ID: 98589
SMILES:CC1C2C(C(O)C(C)=CC2)c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.365
InChIKey:LRHIFQQYOSHCKR-UHFFFAOYSA-N
ID: 98590
SMILES:c1(CCCC)cc(O)c2c(c1)OC(C)(C)C1CCC(C)(O)C(O)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -17.628
InChIKey:FZPZZJPSHOYKIF-UHFFFAOYSA-N
ID: 98591
SMILES:C1CC23Cc4c(cc(C)cc4O)OC2(C=CC(C)(O)C)Oc2c4c(c(C)ccc4c2)ccc(C)c13
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 468.593
CB1 binding score: -15.327
InChIKey:UKQNDJWOSHJWFP-UHFFFAOYSA-N
ID: 98592
SMILES:C12(C)Oc3c(c(O)cc(CCC(CC)O)c3)C3CC(C)CCC3C(C)(C1=C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.116
InChIKey:MCSAZBVKWPJHIC-UHFFFAOYSA-N
ID: 98593
SMILES:C(Cc1cc2c(c(O)c1)C1C(CCC(CO)=C1)C(C)(C)O2)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.303
InChIKey:KWYGDRJJQMACCD-UHFFFAOYSA-N
ID: 98594
SMILES:C(c1c(OC(=O)C)cc(CCCCC)cc1O)(CC1C(C)(C)C(OC(=O)C)CCC1=C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -16.765
InChIKey:VONUMFKFBWFSRR-UHFFFAOYSA-N
ID: 98595
SMILES:c1c(OC)c(OC)cc2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -19.512
InChIKey:XSVIAZSLVNZZSQ-UHFFFAOYSA-N