ID: 97273
SMILES:c12cc(CCCCC)cc(O)c1c(C=O)c(O)c(CC=C(CCC=C(C)C)C)c2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -17.026
InChIKey:OREAFMVNPYFSJZ-UHFFFAOYSA-N
ID: 97274
SMILES:C1(C)=CC(c2ccc(CCCCC)cc2)C(C(C)(C)O)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -18.046
InChIKey:MXECOWWPQRFPTG-UHFFFAOYSA-N
ID: 97275
SMILES:c1ccc2c(c1)-c1c(cc(C)cc1O)OC2(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 240.302
CB1 binding score: -18.341
InChIKey:HDTNPKHDRZGWQJ-UHFFFAOYSA-N
ID: 97276
SMILES:C(CCCC)Cc1cc(O)c2c(c1)OC(C1CC=C(C)CO1)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.462
InChIKey:MYLFTJUCVKNHOQ-UHFFFAOYSA-N
ID: 97277
SMILES:C(C1C(C)(C)O1)CC(=CCCC1(C)Oc2ccc(O)cc2C=C1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.509
InChIKey:XTVFMVOKSWJIQO-UHFFFAOYSA-N
ID: 97278
SMILES:c1(CCCCC)c(C(O)=O)c(O)c2c(c1)C1CC(C)(CCC1C(=C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -15.607
InChIKey:KSDWIVCJEAUKCT-UHFFFAOYSA-N
ID: 97279
SMILES:c12cc(CCCCC)cc3c1C1C(C(C)(O)CCC1C(C)(C)O2)C1CC(C)(O3)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.726
InChIKey:YFXZUKSTONKVSU-UHFFFAOYSA-N
ID: 97280
SMILES:Oc1c2c(cc(CCCC)c1)OC(C)(C)C1C2C=C(C)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.962
InChIKey:MVBUZUVPKJXXNR-UHFFFAOYSA-N
ID: 97281
SMILES:CC1(C)C(CC=C(C)C)CC2(CC=C(C)C)c3c(o2)cc(O)cc3O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 342.479
CB1 binding score: -15.929
InChIKey:VVGKVDZRQAZYPW-UHFFFAOYSA-N
ID: 97282
SMILES:O=C(c1c(CCCCC)cc2c(c1O)C1C(C(O)(C)C)CCC(C)(O2)C1)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.493
CB1 binding score: -16.688
InChIKey:AQOYYYXONBJKLT-UHFFFAOYSA-N
ID: 97283
SMILES:O1C(CO)C(O)C(O)C(O)C1Oc1c(-c2c(O)cc(CCCCC)cc2O)cc(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 654.841
CB1 binding score: -15.041
InChIKey:OSEKBCVDLSANLC-UHFFFAOYSA-N
ID: 97284
SMILES:C12(C)CCOC1c1c(cc(CCCCC)c(C(=O)OC)c1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.466
CB1 binding score: -15.021
InChIKey:CTHPTAOAUAVIKK-UHFFFAOYSA-N
ID: 97285
SMILES:C(CCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(CCC=C(C)C)C1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.097
InChIKey:ORAYZSUMENOUAH-UHFFFAOYSA-N
ID: 97286
SMILES:C1C2C(C)(C)Oc3c(c(O)c(C=O)c(C)c3O)C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.592
InChIKey:BXTBASVOKCMELW-UHFFFAOYSA-N
ID: 97287
SMILES:C(=C(C)C)CCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 97288
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1CC(COC)C3CC=C(C)C3CC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -15.076
InChIKey:NYLFMEIPBNJGFD-UHFFFAOYSA-N
ID: 97289
SMILES:C1CC(O)(C)CC2C(C(C)(C)Oc3cc(CCc4ccc(OC)cc4)cc(O)c(=O)c32)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.645
CB1 binding score: -16.903
InChIKey:FSBUUDPPMLUFSQ-UHFFFAOYSA-N
ID: 97290
SMILES:C1(C)=CC(c2c(O)ccc(CCCCC)c2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.247
InChIKey:IJXLDZIYGDHKBA-UHFFFAOYSA-N
ID: 97291
SMILES:c1(Br)c(OCC)c2c(c(OC)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 381.31
CB1 binding score: -16.548
InChIKey:HGMZLYCRHIMINT-UHFFFAOYSA-N
ID: 97292
SMILES:Oc1cc(CC)c2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.12
InChIKey:FJZYTAGYRKTQIY-UHFFFAOYSA-N
ID: 97293
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -19.932
InChIKey:YRIJETKCLFDWJX-UHFFFAOYSA-N