ID: 57898
SMILES:C(CC(C)=CCc1c(OC(=O)C)c2c(cc1O)OC(C)(C)C1CCC(C)=CC21)CC=C(CCC=C(C)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 520.754
CB1 binding score: -15.573
InChIKey:AKSGHEAETPSXSL-UHFFFAOYSA-N
ID: 57899
SMILES:C(Cl)Cc1cc(O)c(CC=C(C)CCC=C(C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.849
CB1 binding score: -16.08
InChIKey:IPWHOLQMDIJSTD-UHFFFAOYSA-N
ID: 57900
SMILES:C(C)(CCCC(c1cc(CCCCC)cc2c1C1C(C(C)(C)O2)CCC(C)=C1)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.642
CB1 binding score: -15.29
InChIKey:JRIIQEHCSACQQR-UHFFFAOYSA-N
ID: 57901
SMILES:Oc1cc(CCc2ccccc2C)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.513
CB1 binding score: -15.559
InChIKey:HTCPUVDDVHBSJH-UHFFFAOYSA-N
ID: 57902
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 57903
SMILES:C(C)C=CCc1cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -15.758
InChIKey:XXOHQBMIMHZUJX-UHFFFAOYSA-N
ID: 57904
SMILES:c1c(CCCCC)cc2c(c1O)C1=C(C(C)(C)C(=O)CC1)CCC2C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.629
InChIKey:YLGCPEFMGZXYDL-UHFFFAOYSA-N
ID: 57905
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 57906
SMILES:CC(C)=CCCC(C)=CCc1c(O)cc(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 57907
SMILES:C(CCC=C(C)C)(CCCC(C)=CCc1cc(O)c(C)cc1O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.334
InChIKey:RUTPKBVACOSZDU-UHFFFAOYSA-N
ID: 57908
SMILES:C(=O)(OC1C(C)=CCC2C(C)(C)Oc3cc(CCCCC)cc(C(=O)OC)c3OC21)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -14.214
InChIKey:JDHYUPHYHJZWDP-UHFFFAOYSA-N
ID: 57909
SMILES:C1C(C=C(CCC=C(C)C)C)Oc2c(c(O)cc(CCCCC)c2)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -16.582
InChIKey:GLBNDEYDNOXFCU-UHFFFAOYSA-N
ID: 57910
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 57911
SMILES:C(C(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 57912
SMILES:O1c2c(c(O)cc(CCCCC)c2)C2C(C3C(C)CC4C3C(=CC(=O)C4(O)C)C2)C1=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.565
CB1 binding score: -15.752
InChIKey:YMDAKNFKGIFACL-UHFFFAOYSA-N
ID: 57913
SMILES:C1C(C)(C)C2C(C)(C=C1)Oc1cc(CCCCC)c(C(=O)O)cc1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.364
InChIKey:CDGKBUCQOPFSPU-UHFFFAOYSA-N
ID: 57914
SMILES:C1CCc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 220.312
CB1 binding score: -16.022
InChIKey:LDQLDCIZPUPWSN-UHFFFAOYSA-N
ID: 57915
SMILES:C(CCCCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2C2C(C)(O)CCC2C(C=CC=C(C(=O)OC)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 538.769
CB1 binding score: -13.805
InChIKey:XKBKCUOIGVJAJW-UHFFFAOYSA-N
ID: 57916
SMILES:C1(C)(C)C(C)c2c(cc(C)c(CCCCC)c2)OC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.421
CB1 binding score: -15.929
InChIKey:WNWABUNRIKZEDM-UHFFFAOYSA-N
ID: 57917
SMILES:C1(O)Cc2c(c(O)ccc2O)CC1C(CCC=C(C)C)(OC)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.429
CB1 binding score: -15.12
InChIKey:OKFJSPQBMPQEEB-UHFFFAOYSA-N
ID: 57918
SMILES:C(CCCc1cc2c(c(O)c1)C1C(O1)C1CC(C)(C(O)CC1C(C)(C)O)C2)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -15.126
InChIKey:MQLYLQLYRWGZBD-UHFFFAOYSA-N