ID: 116026
SMILES:C1C(O)C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(O)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -15.573
InChIKey:NVFCMLQODWLABB-UHFFFAOYSA-N
ID: 116027
SMILES:C(CC)CCc1c(O)c2c(c(OC)c1)OC1(C(O)=O)CCC(=C(C)C)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -13.031
InChIKey:VQIWLJIYYINVML-UHFFFAOYSA-N
ID: 116028
SMILES:c12c(cc(C)cc1)C(C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.213
InChIKey:ABQUTLCPMMOSHA-UHFFFAOYSA-N
ID: 116029
SMILES:c1(O)c(C2C=C(C)CCC2C(C)=C)c(O)c(C=O)c(O)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 318.369
CB1 binding score: -14.944
InChIKey:WPPPSGAGULOBIQ-UHFFFAOYSA-N
ID: 116030
SMILES:C12C(=CC(C)=CC1)c1c(O)cc(CCCCC)cc1OC(c1cc(O)c(CC=C)cc1O)CC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 488.668
CB1 binding score: -15.133
InChIKey:FJIAGQMACUHTMA-UHFFFAOYSA-N
ID: 116031
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.423
InChIKey:MRLLOLSGDYQJHB-UHFFFAOYSA-N
ID: 116032
SMILES:C(=C(C)CCC=C(CC(O)C1C(C)(C)O1)C)Cc1c(O)cc(CC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.521
CB1 binding score: -14.758
InChIKey:MEXUGCLCBLUYQE-UHFFFAOYSA-N
ID: 116033
SMILES:C1C(C)C(C)(C)Oc2c1cc(CCCCC)cc2OC(=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -15.446
InChIKey:RTJWLYRIBUMQEJ-UHFFFAOYSA-N
ID: 116034
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116035
SMILES:C1(C(OO)(C)C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -16.338
InChIKey:YEOLFRVPTUNFAV-UHFFFAOYSA-N
ID: 116036
SMILES:C12Oc3cc(O)cc(OC)c3C1C=C(C)CCC=C(C)CC2C=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.49
CB1 binding score: -15.96
InChIKey:SBRIOFRZMPYMIS-UHFFFAOYSA-N
ID: 116037
SMILES:C1(C)=CCC(C(C)C)CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -17.857
InChIKey:OPAGHMASMXIGBY-UHFFFAOYSA-N
ID: 116038
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 116039
SMILES:C1=C2c3c(O)cc(CCC)cc3OC(C)(C)C2CCC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.82
InChIKey:PIIAJIAVPVKMDD-UHFFFAOYSA-N
ID: 116040
SMILES:O1c2c(c(O)c(C(=O)OC)c(CCCCC)c2)OC(CCC=C(C)C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -14.008
InChIKey:GUUDNCDTDPCDMZ-UHFFFAOYSA-N
ID: 116041
SMILES:CC1=CCC(C(C)(O)C)C(c2c(O)cc(CCC)cc2O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.987
InChIKey:CYWNGHQPFIJSAD-UHFFFAOYSA-N
ID: 116042
SMILES:C(CC)c1cc(O)c2c(c1C=O)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -16.895
InChIKey:LJRPEALRNVLNAQ-UHFFFAOYSA-N
ID: 116043
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116044
SMILES:CC1(C)Oc2c(C(C(C)C)=O)c(O)c(CC=C(C)C)c(O)c2C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Phloroglucinols
Class: Cannabinoids;Prenylated,geranylated phloroglucinols
MW: 398.543
CB1 binding score: -16.829
InChIKey:OINXVRMTBREKFN-UHFFFAOYSA-N
ID: 116045
SMILES:C12C(C)(C)Oc3cc(CCCCC)cc(O)c3C1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 116046
SMILES:C12C(CC(Oc3cc(CCCCC)ccc31)C(C(O)=CC(=O)C)C(C)C)C(=O)NC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 413.558
CB1 binding score: -14.847
InChIKey:ICCNVQFFPBJAGC-UHFFFAOYSA-N