ID: 138559
SMILES:O1c2c(c(O)cc(CCCCCCCCCC)c2)CC2C(C(C)=C)CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.603
CB1 binding score: -16.594
InChIKey:WFKQVHSZXNGAEL-UHFFFAOYSA-N
ID: 138560
SMILES:O(C1OC(CO)C(O)C(O)C1O)C(C1(C(O)=O)OC2C3c4c(O)cc(CCCCC)cc4OC(C1)(C3O)C2(O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 584.615
CB1 binding score: -11.424
InChIKey:QKHDCWOECUWHQO-UHFFFAOYSA-N
ID: 138561
SMILES:c12c(OC)c(OC)cc3c1C1C(CCC(C)=C1)C(C)(C)Oc1cc(cc(C)c1)OC(C)(CC2)C3CC(=O)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 546.748
CB1 binding score: -14.898
InChIKey:QCKFIABYABMOSV-UHFFFAOYSA-N
ID: 138562
SMILES:C1C(O)(C)C2C3C(C)(C)Oc4c5c(c(O)cc(C)c5c4C=C2C(O)C1)C3OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.374
InChIKey:CKXXLCQIRZARIG-UHFFFAOYSA-N
ID: 138563
SMILES:C1(C)CC2C3c4c(cc(C)c(OC(CCCCCCC(OC)CCCC)=O)c4O)OC2(C)CC3C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 486.693
CB1 binding score: -17.439
InChIKey:GMWQTJDSXCEBAN-UHFFFAOYSA-N
ID: 138564
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C(O)=O)=CCC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.707
InChIKey:OGXXAQFMAFTSRU-UHFFFAOYSA-N
ID: 138565
SMILES:C(C)(C)C1CCC(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.815
InChIKey:PCXRACLQFPRCBB-UHFFFAOYSA-N
ID: 138566
SMILES:C1=CCCC(C)C12c1c(cc(CCCCC)cc1O)OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.635
InChIKey:WNRMWYGMGMJNCE-UHFFFAOYSA-N
ID: 138567
SMILES:C(C(=CCc1c(O)cc(CCCCC)cc1OC)CO)=CC(C)(O)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -14.063
InChIKey:CXJWZYYYWWTOLK-UHFFFAOYSA-N
ID: 138568
SMILES:C1C(C(OC)=O)=C(C)C(c2c(O)cc(CCCCC)cc2O)C(C(=C)C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.261
InChIKey:SSICXMZXNBCRCV-UHFFFAOYSA-N
ID: 138569
SMILES:c1(C)cc(O)c(C2(C)CC=C(CC=O)C2CCC(C=C)(C)O)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -15.519
InChIKey:KBRFVSUKDKUDHE-UHFFFAOYSA-N
ID: 138570
SMILES:c1(O)c2c(cc(CCC)c1)OC(C)(C)c1cc(O)c(C)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.382
CB1 binding score: -16.979
InChIKey:HAZNHGCZSAUBNU-UHFFFAOYSA-N
ID: 138571
SMILES:c1c(O)c(C2C(C(=C)C(=O)O)CC=C(C)C2)c(O)cc1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -15.132
InChIKey:SNOYWBGKPCSQMJ-UHFFFAOYSA-N
ID: 138572
SMILES:c1c(CCCCC)[nH]c2c1c1c(cc2)OC(C)(C)C2CC=C(C)CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 351.534
CB1 binding score: -12.326
InChIKey:KHLBFHKYSGGLJW-UHFFFAOYSA-N
ID: 138573
SMILES:C1C(C)=CC(c2c(O)cc(CCCCC)cc2O)C(C=C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -18.028
InChIKey:KIFZHNQESZKPAZ-UHFFFAOYSA-N
ID: 138574
SMILES:Oc1cc(C)cc(O)c1C1(C)C(C(=CCC2OC2(C)C)C)CCC1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.301
InChIKey:QNVSWPLLONJKIU-UHFFFAOYSA-N
ID: 138575
SMILES:C1(C(C)=C)CCC(C)=C1c1c(OC(=O)C)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.924
InChIKey:FHMPFWRYUPJGOL-UHFFFAOYSA-N
ID: 138576
SMILES:C1CC(C)=CC(c2cc(CCC)ccc2OC)C1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.443
CB1 binding score: -15.166
InChIKey:ATQGMEKENLDYHH-UHFFFAOYSA-N
ID: 138577
SMILES:CC(C)=CCCC(C)=CCCC(C)=CCc1c(OC)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 398.631
CB1 binding score: -18.943
InChIKey:QOVOSRUONCHPIN-UHFFFAOYSA-N
ID: 138578
SMILES:C(O)CCc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(C=O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.425
CB1 binding score: -14.948
InChIKey:RWCXJAKUEFHEIE-UHFFFAOYSA-N
ID: 138579
SMILES:C1C(Br)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 327.262
CB1 binding score: -18.565
InChIKey:QNWMKTBWRYYNDW-UHFFFAOYSA-N