ID: 53971
SMILES:c12c(c(O)cc(CCCCC)c1)C1(C)C(C)(CCC(C)=CC1)C(Br)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 405.42
CB1 binding score: -14.614
InChIKey:SCLYCWTZXLZLOW-UHFFFAOYSA-N
ID: 53972
SMILES:O=C1C2=C(c3c(cc(CCCCC)cc3O)OC2(C)C)C(=O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.435
CB1 binding score: -17.144
InChIKey:SBTZBSSVWDAEIW-UHFFFAOYSA-N
ID: 53973
SMILES:C(C=C(C)C(O)=O)CC(C)=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.476
CB1 binding score: -16.995
InChIKey:XPNJKZHRKLTHCD-UHFFFAOYSA-N
ID: 53974
SMILES:CC1=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3O)C2C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.879
InChIKey:ZBTJYLDHRSLXAE-UHFFFAOYSA-N
ID: 53975
SMILES:C(CC(O)C(C)=CCc1c(O)cc(CCCCC)cc1O)(C)C=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -14.661
InChIKey:BULMUTNRLZOEDE-UHFFFAOYSA-N
ID: 53976
SMILES:C1(CCC=C(CO)C)=Cc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.301
InChIKey:ZSAHAVKYPFOEHZ-UHFFFAOYSA-N
ID: 53977
SMILES:CC(=CCCC1(C)Oc2cc(CCCCC)c(O)cc2C=C1)CO
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.695
InChIKey:RUOJZPSLWGKJSC-UHFFFAOYSA-N
ID: 53978
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2C=C(C(O)=O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.285
InChIKey:YSFCPZIJDAJXFM-UHFFFAOYSA-N
ID: 53979
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2C=C(C(=O)O)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -20.052
InChIKey:YOVRGSHRZRJTLZ-UHFFFAOYSA-N
ID: 53980
SMILES:CC(=O)Oc1cc(CCCC)cc2c1OC(C)(C)C1OC1C=C(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.434
InChIKey:VVHHMZRVOFCQSP-UHFFFAOYSA-N
ID: 53981
SMILES:C(c1cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.344
CB1 binding score: -19.395
InChIKey:VTKCSOVWESGERA-UHFFFAOYSA-N
ID: 53982
SMILES:c12cc(CCCCC)cc(OC)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 53983
SMILES:O=C(CCCC)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -16.219
InChIKey:HAKKJJYARNCYGR-UHFFFAOYSA-N
ID: 53984
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1=C=C(C(C)(O)C)C(=O)CC1(C)C2)CNC(=O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 413.514
CB1 binding score: -16.655
InChIKey:OVIOHLWRQCGJDC-UHFFFAOYSA-N
ID: 53985
SMILES:C12(COc3cc(CCCCC)cc(O)c31)C(C)(C)C(C)CC=C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -14.501
InChIKey:IWNJNAINNRSIPQ-UHFFFAOYSA-N
ID: 53986
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(CC=C(C)C1)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -15.922
InChIKey:INMPUVWCEJGBMT-UHFFFAOYSA-N
ID: 53987
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(C(O)=O)c(CCCCC)c1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.521
InChIKey:YNICQFSDPAXQPZ-UHFFFAOYSA-N
ID: 53988
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1(O)CCC(O)(C)C=C21)C=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.57
CB1 binding score: -14.32
InChIKey:SXRYPTNZWSOKLN-UHFFFAOYSA-N
ID: 53989
SMILES:C1CC2C(C)(C)Oc3c(cc(OC(=O)C)cc3)C2C=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -18.127
InChIKey:JZZHXSIRDHGYSQ-UHFFFAOYSA-N
ID: 53990
SMILES:Oc1c(CC=C(CCC=C(C)C)C)cc(O)cc1CC=C(C)CO
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.021
InChIKey:NJLMHXHDSBLOOR-UHFFFAOYSA-N
ID: 53991
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -17.784
InChIKey:QPUHYZGLKQWEKI-UHFFFAOYSA-N